chempirical

2-(Hydroxymethyl)anthraquinone

C15H10O3CAS 17241-59-7238.24 g/mol

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Properties

Molecular formula
C15H10O3
Molar mass
238.24 g/mol
Exact mass
238.0630 Da
Melting point
183 °C
logP
1.95Crippen estimate
Polar surface area
54.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Identifiers

CAS number
17241-59-7
SMILES
O=C1c2ccccc2C(=O)c2cc(CO)ccc21
InChIKey
JYKHAJGLEVKEAA-UHFFFAOYSA-N
InChI
InChI=1S/C15H10O3/c16-8-9-5-6-12-13(7-9)15(18)11-4-2-1-3-10(11)14(12)17/h1-7,16H,8H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

4 names
  • 9,10-Anthracenedione, 2-(hydroxymethyl)-
  • Anthraquinone, 2-(hydroxymethyl)-
  • 2-(Hydroxymethyl)-9,10-anthracenedione
  • 2-(Hydroxymethyl)-9,10-anthraquinone

Work with 2-(Hydroxymethyl)anthraquinone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Ethylanthraquinone84-51-564 % similar 2-Pentyl-9,10-anthracenedione13936-21-557 % similar 2-Hydroxyanthraquinone605-32-355 % similar Anthraquinone84-65-152 % similar Aloe emodin481-72-151 % similar 2-Anthraquinonecarboxylic acid117-78-250 % similar 2-Aminoanthraquinone117-79-350 % similar 2-Chloroanthraquinone131-09-950 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

7-Hydroxyisoflavone13057-72-2 4,5-Diphenyl-1,3-dioxol-2-one21240-34-6 5-Hydroxyflavone491-78-1 3-Hydroxyflavone577-85-5 6-Hydroxyflavone6665-83-4 7-Hydroxyflavone6665-86-7

Elsewhere

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